CID 170535

Einecs 255-443-4

Structural Information

Molecular Formula
C23H25ClN2
SMILES
CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=CC=CC=C3Cl
InChI
InChI=1S/C23H25ClN2/c1-25(2)19-13-9-17(10-14-19)23(21-7-5-6-8-22(21)24)18-11-15-20(16-12-18)26(3)4/h5-16,23H,1-4H3
InChIKey
JPPVTKZGOJUZKN-UHFFFAOYSA-N
Compound name
4-[(2-chlorophenyl)-[4-(dimethylamino)phenyl]methyl]-N,N-dimethylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

364.17062 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.17790 190.5
[M+Na]+ 387.15984 196.3
[M-H]- 363.16334 202.2
[M+NH4]+ 382.20444 204.1
[M+K]+ 403.13378 191.2
[M+H-H2O]+ 347.16788 180.7
[M+HCOO]- 409.16882 210.4
[M+CH3COO]- 423.18447 229.0
[M+Na-2H]- 385.14529 191.5
[M]+ 364.17007 194.3
[M]- 364.17117 194.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe